2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 4-(2,5-dimethyl-3-thienyl)-4-oxo-butanoate CAS Name: 4-(2,5-dimethyl-3-thiophenyl)-4-oxobutanoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 4-(2,5-dimethylthiophen-3-yl)-4-oxobutanoate Traditional Name: 4-(2,5-dimethyl-3-thienyl)-4-keto-butyric acid 2-phthalimidoethyl ester Formula: C20H19NO5S MolecularWeight: 385.43356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)CCC(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)CCC(=O)OCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H19NO5S/c1-12-11-16(13(2)27-12)17(22)7-8-18(23)26-10-9-21-19(24)14-5-3-4-6-15(14)20(21)25/h3-6,11H,7-10H2,1-2H3